hexyl 5-methyl-5-(2,2,4-trimethyl-6-oxidanyl-3,4-dihydrochromen-7-yl)hexanoate

Systemtic Name: hexyl 5-methyl-5-(2,2,4-trimethyl-6-oxidanyl-3,4-dihydrochromen-7-yl)hexanoate Openeye Name: hexyl 5-(6-hydroxy-2,2,4-trimethyl-chroman-7-yl)-5-methyl-hexanoate CAS Name: 5-(6-hydroxy-2,2,4-trimethyl-3,4-dihydro-2H-1-benzopyran-7-yl)-5-methylhexanoic acid hexyl ester IUPAC Name: hexyl 5-(6-hydroxy-2,2,4-trimethyl-3,4-dihydrochromen-7-yl)-5-methylhexanoate Traditional Name: 5-(6-hydroxy-2,2,4-trimethyl-chroman-7-yl)-5-methyl-hexanoic acid hexyl ester Formula: C25H40O4 MolecularWeight: 404.5827

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CCCC(C)(C)C1=C(C=C2C(CC(OC2=C1)(C)C)C)O

Isomeric SMILES

CCCCCCOC(=O)CCCC(C)(C)C1=C(C=C2C(CC(OC2=C1)(C)C)C)O

InChI

InChI=1S/C25H40O4/c1-7-8-9-10-14-28-23(27)12-11-13-24(3,4)20-16-22-19(15-21(20)26)18(2)17-25(5,6)29-22/h15-16,18,26H,7-14,17H2,1-6H3